Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 7/20 | 0.45 |
| ▸ | CTSS | P25774 | 4/20 | 0.45 |
| ▸ | CTSB | P07858 | 3/20 | 0.45 |
| ▸ | ITGAV | P06756 | 3/20 | 0.44 |
| ▸ | CTSK | P43235 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | ESRRG | P62508 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL6442065 | 0.90 | CTSL (0.54) | CTSLCTSSCTSBITGAVCTSK | |
| SCHEMBL6443463 | 0.87 | KDM4E (0.46) | CTSLCTSSCTSBNPC1RAB9A | |
| SCHEMBL6442880 | 0.86 | EPHX2 (0.39) | SMN1; SMN2ESRRGPOLBEPHX2 | |
| SCHEMBL6442163 | 0.85 | TP53 (0.48) | SMN1; SMN2POLBEPHX2GAA | |
| SCHEMBL6443755 | 0.84 | GAA (0.40) | CTSLCTSSCTSBCTSKNPC1 | |
| SCHEMBL6822806 | 0.84 | POLB (0.52) | CTSLNPC1POLB | |
| SCHEMBL6446318 | 0.83 | NPC1 (0.42) | NPC1RAB9ASMN1; SMN2LMNAPOLB | |
| SCHEMBL6443785 | 0.81 | CTSL (0.44) | CTSLCTSSCTSBCTSKNPC1 | |
| SCHEMBL6444783 | 0.81 | ALDH1A1 (0.47) | NPC1RAB9ALMNAPOLBMAPT | |
| SCHEMBL6443588 | 0.80 | NPC1 (0.51) | CTSLCTSSCTSBCTSKNPC1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004056755-A2 | COMPOUNDS FOR THE INHIBITION OF NON-PROTEOLYTIC ENZYMES | JERENI AG (DE) | 2004-07-08 | — | — | WO | claimed |
| EP-1575903-A1 | COMPOUNDS FOR THE INHIBITION OF ROTAMASES | Jerini AG (DE) | 2005-09-21 | — | — | EP | disclosed |
| WO-2004065353-A1 | COMPOUNDS FOR THE INHIBITION OF ROTAMASES | JERINI AG (DE) | 2004-08-05 | — | — | WO | disclosed |